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137788-50-2

137788-50-2 | 1-Propanol, 3-[[[4-(dimethylamino)phenyl]methyl]amino]-

CAS No: 137788-50-2 Catalog No: AG0013UT MDL No:

Product Description

Catalog Number:
AG0013UT
Chemical Name:
1-Propanol, 3-[[[4-(dimethylamino)phenyl]methyl]amino]-
CAS Number:
137788-50-2
Molecular Formula:
C12H20N2O
Molecular Weight:
208.3000
IUPAC Name:
3-[[4-(dimethylamino)phenyl]methylamino]propan-1-ol
InChI:
InChI=1S/C12H20N2O/c1-14(2)12-6-4-11(5-7-12)10-13-8-3-9-15/h4-7,13,15H,3,8-10H2,1-2H3
InChI Key:
SHCKXJGSQBJHDT-UHFFFAOYSA-N
SMILES:
OCCCNCc1ccc(cc1)N(C)C

Properties

Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.158g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.305g/mol
Monoisotopic Mass:
208.158g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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